CID 66771371

1252760-19-2

Structural Information

Molecular Formula

C₁₀H₉ClO₃

SMILES

C1CC1(C(=O)O)OC2=CC=C(C=C2)Cl

InChI

InChI=1S/C10H9ClO3/c11-7-1-3-8(4-2-7)14-10(5-6-10)9(12)13/h1-4H,5-6H2,(H,12,13)

InChIKey

BVOVUSTVSOEJLN-UHFFFAOYSA-N

Compound name

1-(4-chlorophenoxy)cyclopropane-1-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 22
Patents: 212.02402 Da
Monoisotopic Mass: 2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	213.03130	143.6
[M+Na]+	235.01324	158.1
[M+NH4]+	230.05784	154.0
[M+K]+	250.98718	151.7
[M-H]-	211.01674	153.0
[M+Na-2H]-	232.99869	154.7
[M]+	212.02347	149.9
[M]-	212.02457	149.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe